1-[[6-cyano-2,2-dimethyl-4-(2-oxidanylidenepyridin-1-yl)chromen-3-yl]methyl]-3-ethyl-urea

Systemtic Name: 1-[[6-cyano-2,2-dimethyl-4-(2-oxidanylidenepyridin-1-yl)chromen-3-yl]methyl]-3-ethyl-urea Openeye Name: 1-[[6-cyano-2,2-dimethyl-4-(2-oxo-1-pyridyl)chromen-3-yl]methyl]-3-ethyl-urea CAS Name: 1-[[6-cyano-2,2-dimethyl-4-(2-oxo-1-pyridinyl)-1-benzopyran-3-yl]methyl]-3-ethylurea IUPAC Name: 1-[[6-cyano-2,2-dimethyl-4-(2-oxopyridin-1-yl)chromen-3-yl]methyl]-3-ethylurea Traditional Name: 1-[[6-cyano-4-(2-keto-1-pyridyl)-2,2-dimethyl-chromen-3-yl]methyl]-3-ethyl-urea Formula: C21H22N4O3 MolecularWeight: 378.42438

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)NCC1=C(C2=C(C=CC(=C2)C#N)OC1(C)C)N3C=CC=CC3=O

Isomeric SMILES

CCNC(=O)NCC1=C(C2=C(C=CC(=C2)C#N)OC1(C)C)N3C=CC=CC3=O

InChI

InChI=1S/C21H22N4O3/c1-4-23-20(27)24-13-16-19(25-10-6-5-7-18(25)26)15-11-14(12-22)8-9-17(15)28-21(16,2)3/h5-11H,4,13H2,1-3H3,(H2,23,24,27)